N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-butyl-5-methyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-butyl-5-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-5-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-N-butyl-5-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-butyl-5-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-5-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C26H28N6O3 MolecularWeight: 472.53892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3=C(N(N=C3)C4=CC=CC=C4)C

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3=C(N(N=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C26H28N6O3/c1-3-4-15-30(25(34)21-16-28-32(18(21)2)20-13-9-6-10-14-20)22-23(27)31(26(35)29-24(22)33)17-19-11-7-5-8-12-19/h5-14,16H,3-4,15,17,27H2,1-2H3,(H,29,33,35)